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  1. Third-Parties
  2. MatprojStructure
  3. mp-510099

Entry Data

Table mix-ins: ['Structure', 'Thermodynamics'] Extra columns: ['energy_uncorrected', 'band_gap', 'is_gap_direct', 'is_magnetic', 'total_magnetization', 'is_theoretical']

Base Information:

  • Database Entry ID: mp-510099
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 26
  • Number of elements: 2
  • Element list: ['In', 'Au']
  • Chemical System: Au-In
  • Density: 15.550558071111329
  • Atomic Density: 0.05260831799201098
  • Unit Cell Volume: 494.2184238611909
  • Molar Volume: 11.44712659491321
  • Full Formula: In6 Au20
  • Reduced Formula: In3Au10
  • Formula Anonymous: A3B10
  • Spacegroup Number: 176
  • Spacegroup Symbol: P6_3/m
  • Crystal System: hexagonal
  • Pointgroup: 6/m

Thermodynamics:

  • Final energy: -84.88789887
  • Final energy per atom: -3.2649191873076924
  • Energy above hull: None
  • Is thermodynamically stable?: None
  • Decomposes to: None
  • Formation energy None
  • Formation energy per atom: None
Note: stabilities and hull energies are updated on a running schedule, so newer materials may have these fields blank.